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sodium 4-[4-(prop-2-enoylamino)butoxy]benzenesulfonate

sodium 4-[4-(prop-2-enoylamino)butoxy]benzenesulfonate

Systemtic Name:sodium 4-[4-(prop-2-enoylamino)butoxy]benzenesulfonate
Openeye Name:sodium 4-[4-(prop-2-enoylamino)butoxy]benzenesulfonate
CAS Name:sodium 4-[4-(1-oxoprop-2-enylamino)butoxy]benzenesulfonate
IUPAC Name:sodium 4-[4-(prop-2-enoylamino)butoxy]benzenesulfonate
Traditional Name:sodium 4-(4-acrylamidobutoxy)besylate
Formula: C13H16NNaO5S
MolecularWeight: 321.32461
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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]


Isomeric SMILES

C=CC(=O)NCCCCOC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]


InChI

InChI=1S/C13H17NO5S.Na/c1-2-13(15)14-9-3-4-10-19-11-5-7-12(8-6-11)20(16,17)18;/h2,5-8H,1,3-4,9-10H2,(H,14,15)(H,16,17,18);/q;+1/p-1


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